IBS-ZINC00528795 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8020 -1.8240 1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -2.3530 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -3.7220 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0240 -4.5660 1.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3670 -4.0410 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6730 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 -6.0590 1.7640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -6.5630 2.5190 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -7.8800 2.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -8.9630 2.2440 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -8.3440 3.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 -7.4570 3.9240 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1790 -7.9030 4.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.9700 5.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 -7.4310 5.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -6.5220 6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1550 -5.2370 5.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -4.7610 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1280 -5.5960 4.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -1.6940 3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0820 -4.1340 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -4.7020 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 -2.2640 -0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 -6.5300 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -6.2930 2.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6920 -5.9490 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2470 -9.2910 3.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2640 -8.9580 4.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4380 -8.4810 6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1380 -6.8670 6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0670 -3.7020 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2880 -5.1990 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 M END